Hydration structure of \(\mathrm{Na}^+\) and \(\mathrm{Cl}^-\) ions in Tip3P water model

DOI10.1134/S1995080217050328zbMATH Open1378.81172OpenAlexW2755508256MaRDI QIDQ1682844

E. F. Shiriaeva, Vladimir V. Stegailov

Publication date: 6 December 2017

Published in: Lobachevskii Journal of Mathematics (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1134/s1995080217050328

zbMATH Keywords

molecular dynamicsliquid waterstructure

Mathematics Subject Classification ID

Molecular physics (81V55) Statistical thermodynamics (82B30) Chemistry (general) in thermodynamics and heat transfer (80A50) Molecular, statistical, and kinetic theories in solid mechanics (74A25)

Uses Software

• LAMMPS

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